ethyl (2E)-2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]ethanoate

Systemtic Name: ethyl (2E)-2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]ethanoate Openeye Name: ethyl (2E)-2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxo-thiazolidin-2-ylidene]acetate CAS Name: (2E)-2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxo-2-thiazolidinylidene]acetic acid ethyl ester IUPAC Name: ethyl (2E)-2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate Traditional Name: (2E)-2-[4-keto-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]thiazolidin-2-ylidene]acetic acid ethyl ester Formula: C16H16N2O7S MolecularWeight: 380.37244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C1N(C(=O)CS1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CCOC(=O)/C=C/1\N(C(=O)CS1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C16H16N2O7S/c1-2-24-15(20)5-14-17(13(19)8-26-14)6-10-3-12(18(21)22)4-11-7-23-9-25-16(10)11/h3-5H,2,6-9H2,1H3/b14-5+